Digital Commons Network^™

Intramolecular Nonbonding Interactions And Geared Phenyl Twisting In Para-Disubstituted 1,4-Diphenylazines: Electron Correlation Effects On Molecular Conformations And Enantiomerization, Kaidi Yang, Harmeet Bhoday, Rainer Glaser

Chemistry Faculty Research & Creative Works

The results are reported of potential energy surface (PES) analyses of six symmetrical azines Y_p − Ph − RC=N − N=CR − Ph − Y_p, namely, the benzaldehyde azines 1H, 2H, and 8H with R = H and the acetophenone azines 1M, 2M, and 8M with R = Me. The Y substituents Cl (1), Br (2), and Me (8) were studied because sets of polymorphs I (C2-symmetry, azine twist τ ≈ 135 ± 10°, disrotatory phenyl twists ϕi ≠ 0°) and II (Ci-symmetry, τ = 180°, conrotatory ϕi ≠ 0°) were crystallized for these three azines. The …

Advancing Activated Carbon Production: Utilizing Pine Pruning Biochar Via Induction Heating With Co2and Iron-Based Catalysts, Ahmet Erdem, Muthanna H. Al-Dahhan, Ahmed Jasim

Chemical and Biochemical Engineering Faculty Research & Creative Works

This study introduces an induction heating approach for producing activated carbon from biochar obtained by thermal degradation of pine pruning waste from timber-related industries, using CO₂ and iron-based catalysts as activation agents. Activation experiments were performed using a 10 kW high-frequency induction system (28–40 kHz) under continuous CO₂ flow (15 mL min⁻¹), with electric current intensities of 200, 300, 400, and 500 A (corresponding to 700–1100°C) and durations of 30, 60, and 90 min, employing 45 g of iron-based catalysts (Fe–Ni–Ti–C, 85:6:3:6 wt.%) per 3 g biochar (15:1 w/w). Mass loss increased from 13.7 % (200 A, …

Pointwise Self-Homeomorphic Generalized Inverse Limits, Ali H. Ali, Faruq A. Mena, Robert Paul Roe

Mathematics and Statistics Faculty Research & Creative Works

In this paper, we find uncountable families of generalized inverse sequences on intervals, where the bonding functions consist of a finite number of line segments, such that the inverse limit spaces of these sequences are pointwise self-homeomorphic continua. We give several examples of pointwise self-homeomorphic continua obtained in this manner including the dendrite D3 and a dendrite containing Dω. The dendrite D3 was obtained previously, by others, as a generalized inverse limit but the bonding function in that example contained infinitely many line segments. We show that the techniques we use on intervals can be extended to inverse limits where …

Applying Direct Numerical Simulations To Investigate Wave Forcing Against A Vertical Wall, Hunter Boswell, Frank D. Han, Gaurav Savant, Guirong Yan, Wouter Mostert

Mechanical and Aerospace Engineering Faculty Research & Creative Works

Current engineering standards lack the ability to predict the peak impact forces of breaking waves impinging directly upon coastal structures. In this study solitary waves impacting vertical and tapered walls are investigated. To capture the detailed physics of the wave profile that impacts the wall, two-dimensional direct numerical simulations are applied to model the wave traveling over a simplified bathymetry consisting of an initially uniform depth, followed by a uniform beach ramp and then terminating in a uniform depth inshore region and vertical wall. Such an approach can simulate wave runup on land and then the impact with the vertical …

Data-Driven Non-Precipitation Echo Removal Of Nexrad Radars Based On A Random Forest Classifier Using Polarimetric Observations And Goes-16 Data, Munsung Keem, Bong Chul Seo, Witold F. Krajewski, Sangdan Kim

Civil, Architectural and Environmental Engineering Faculty Research & Creative Works

Highlights: What are the main findings? A Random Forest-based model using dual-polarimetric radar features achieves >99% accuracy in classifying precipitation and non-precipitation echoes. Multi-scale spatial variability features enhance discrimination between genuine precipitation and spurious echoes. Fusion of GOES-16 infrared satellite data with NEXRAD radar effectively removes non-precipitation echoes with precipitation-like signatures, including wind turbine clutter. A CAPPI scan strategy improves near-radar precipitation detection by recovering valid echoes misclassified at the lowest elevation due to side-lobe interference and limited sampling volume. What are the implications of the main findings? The model's robustness to noise and overfitting, combined with minimal hyperparameter tuning, …

Warrior Bot, Relational Bot, Blameworthy Bot: How A Student Design Team Anthropomorphize Their Combat Robot Creations, Daniel Burton Shank, Frederick F. Sunkpal, Nova Lee Young, Karli Hoerstkamp, David Wright, Merilee A. Krueger, Carleigh J. Davis

Psychological Science Faculty Research & Creative Works

How do robot designers anthropomorphize their own creations? Because robot designers have the ability to alter the robot, identify as its creator, and understand their robot's internal makeup, their process of anthropomorphism and its outcomes may be different from that of the typical robot user. We investigate this research question in the domain of combat robots, where anthropomorphism is critical to decision-making, communication, and trust in high-stakes, high-emotion combat situations faced by robot-soldier teams. We conducted an in-depth case study of a university's student-led Combat Robotics Design Team over the design, construction, testing, and competition phases for their competitive combat …

Understanding Human Arm Stiffness Modulation In Overground Phri: The Roles Of Kinematics, Perturbation, And Trunk Sway, Mohsen Mohammadi Beirami, Sambad Regmi, Devin Michael Burns, Yun Seong Song

Psychological Science Faculty Research & Creative Works

This study examines human arm kinematics during overground physical human-robot interaction (pHRI). Previous work showed humans adjust arm stiffness with changing trajectory uncertainty, but the roles of arm kinematics and muscle activation remained unclear. Building on a preliminary study, we analyzed arm movements with more participants (10 individuals) to achieve more reliable findings and examined two potential influences that arose in the preliminary study: the robot's perturbation effect (a brief hand push) and left-to-right trunk sway. Using a linear mixed-effects model, we evaluated the effects of participant, block, and trajectory condition on arm angles. Results showed minimal kinematic contribution to …

Microwave Dielectric Properties Of Geopolymer Precursor Powders, Linh T. Duong, Abu Naser Rashid Reza, Kristen M. Donnell, Christopher R. Shearer

Electrical and Computer Engineering Faculty Research & Creative Works

Geopolymers are sustainable structural materials with properties similar to ordinary Portland cement concrete. To better understand the fundamental reaction mechanisms of geopolymers, a microwave materials characterization approach is used. In this research work, the dielectric properties (permittivity and loss factor) of common precursor powders used to make geopolymers (GPPs)—fly ash, lime, metakaolin, silica fume, slag, and zeolite—are measured over the S- and X-band frequency ranges (i.e., 2.0–4.0 GHz and 8.2–12.4 GHz, respectively). The physical characteristics, elemental composition, mineralogical properties, and phase characterization of the GPPs are then correlated to dielectric properties. Permittivity of GPP, classified as pozzolanic or latent hydraulic, …

Stard-Net: Spatiotemporal Attention For Robust Detection Of Tiny Airborne Objects From Moving Drones, Hasibur Rahman, Sanjay Kumar Madria

Computer Science Faculty Research & Creative Works

The rapid adoption of drones across various domains, alongside advancements in computer vision, has driven growing interest in vision-based airborne object detection from moving aerial platforms. However, this task remains challenging due to the small scale of objects, camouflage within cluttered backgrounds, and occlusions. To address these challenges, we introduce an end-to-end detection framework that integrates a Drone Receptive Field Block (DRFB) to extract multiscale and geometrically diverse features, specifically designed to enhance the detection of small and camouflaged airborne objects. To model motion patterns over time while preserving spatial structure, particularly for detecting camouflaged, cluttered and occluded objects with …

The Effect Of Reduction Of Input-Parameters On Data-Driven Prediction Of Critical Heat Flux In Rod Bundles Using Extended Parameters For Reactor Thermal–Hydraulic Safety, Rehan Zubair Khalid, Atif Khan, Farooq Ahmad, Muthanna H. Al-Dahhan, Atta Ullah

Chemical and Biochemical Engineering Faculty Research & Creative Works

Accurate prediction of the critical heat flux (CHF) is a key pillar for ensuring both the safety and economic performance of nuclear reactors. While machine learning (ML)-based methodologies have demonstrated considerable success in predicting CHF, most existing studies have been confined to simplified geometries, such as single tubes. Conversely, limited attention has been devoted to CHF prediction in realistic reactor environments, particularly within rod bundle configurations, where complex multiphase flow and heat transfer phenomena prevail. In this work we develop different AI models based on large dataset operating conditions as well as the complex geometric features of rod bundles. The …

Sustainable Pathways For Fish Waste Oil Valorization Into Biofuel: Process Synthesis And Case Study, Hany A. Elazab, Radhi H. Alazmi, Abdelrahman El-Bagalaty, Hossam Tammam, Mahmoud El-Sayed, Mohamed Omar, Fathi Shokry, Mamdouh A. Gadalla, Fatma H. Ashour, Thokozani Majozi

Chemical and Biochemical Engineering Faculty Research & Creative Works

Biodiesel is a promising, sustainable alternative to fossil fuels such as petrol and diesel. Currently, biodiesel can be produced from edible plant oils and non-edible sources and wastes. Notably, fish waste oil is a sustainable resource for transesterification reactions to produce biodiesel. This research proposes a general process design methodology to investigate the potential of biodiesel production from fish waste oil as a pathway for waste-to-energy. The methodology integrates Pinch Analysis principles and process simulation to optimize the energy efficiency of a process design. Real data are collected on fish waste from fish industries in Egypt, focusing on three regions …

Applying Two-Stage Risk-Based Market Structures For Energy Hub-Based Plug-In Electric Vehicles Using Information Decision Gap Theory And A Hybrid Recurrent Convolutional Network, A. Heidari, R. C. Bansal, R. Bo

Electrical and Computer Engineering Faculty Research & Creative Works

This paper investigates the optimal operation of an energy hub engaged in both day-ahead and real-time trading. A two-stage optimization framework Information Gap Decision Theory (IGDT) for day-ahead bidding and stochastic programming with Monte Carlo scenarios for real-time recourse is applied. Risk-neutral, risk-averse, and risk-taking strategies are considered to capture different risk preferences. The hub integrates combined heat and power, renewable energy, plug-in electric vehicles, and vehicle-to-grid and grid-to-vehicle technologies. Price and load forecasts are generated using a hybrid recurrent convolutional network (HRCN). Results highlight the trade-off between risk management and economic performance: costs are 16.5 % higher in the …

Magnetic Field Tuned Magnetic Order And Metamagnetic Criticality In Nonstoichiometric Ceaubi2, Halyna Hodovanets, Hyunsoo Kim, Tristin Metz, Yasuyuki Nakajima, Christopher J. Eckberg, Kefeng Wang, Jie Yong, Shanta R. Saha, David Graf, Nicholas P. Butch, Thomas Vojta, Johnpierre Paglione

Physics Faculty Research & Creative Works

We present a detailed study of magnetization, resistivity, heat capacity, and x-ray and neutron powder diffraction measurements performed on single crystals of nonstoichiometric CeAuBi₂, Au deficiency 18%, a strongly correlated antiferromagnet with Néel temperature T_N = 13.2 K. Field-dependent magnetization measurements reveal a large magnetic anisotropy at low temperatures with an easy axis along the crystallographic c axis, in which direction a spin-flop transition exhibits strong features in magnetization, specific heat, and resistivity at H_c = 75 kOe. The constructed temperature-field phase diagram connects this transition to the suppression of magnetic order, which evolves from a …

A Photosynthetic–Respiratory Electron Transport Chain Chimera Based On Photosystem I And Cytochrome C Oxidase On Graphene Oxide, Xiaoping Zhu, Matthew J. Kummer, Carolyn E. Lubner, Vasily Kurashov, William Carr, John H. Golbeck, Robert A. Niederman, Lev G. Mourokh, Shelley D. Minteer, Paul G. Falkowski, Michele Vittadello

Chemistry Faculty Research & Creative Works

Te self-assembly of enzyme proteins on 2D nanomaterials has enabled the construction and functional control of viable biochemical pathways. However, enzymatic cascades, which combine essential components of the photosynthetic and respiratory electron transport chains in tandem, have thus-far remained elusive. Herein, we have investigated a galvanic biohybrid nano system coupling photosystem I and cytochrome c oxidase on the surface of graphene oxide nanosheets in colloidal suspension. Te oriented immobilization of the enzymes was facilitated by Ni-coordination sites tethered to the carbon basal plane, with negligible parasitic O2 consumption. Transient absorption and electrochemical measurements provided evidence of electron transfer between donors …

Hardness Of (Hf,Ti,W,Zr)B2/(Hf,Ti,W,Zr)C-Based Ceramics With Varying Wb Content, Suzana Filipović, William G. Fahrenholtz, Gregory E. Hilmas, Nina Obradović, Stefano Curtarolo

Materials Science and Engineering Faculty Research & Creative Works

Compositionally complex (Hf,Ti,Zr,W)B₂/(Hf,Ti,Zr,W)C-based ceramics were produced with different boride and carbide phase contents by varying the C/B₄C molar ratio used in boro/carbothermal reduction. A monoboride phase based on WB was detected in all compositions. As the C/B₄C ratio was varied, the WB content decreased from 23.7 vol% for a C/B₄C ratio of 6.0–15.3 vol% for a C/B₄C ratio of 10.3. Further increases in the C/B₄C ratio increased the WB content. The monoboride phase contained mainly W and Ti in a solid solution with the nominal composition of (W …

Rheological Modification Of Alkali-Activated Slag Mortar: Roles Of Sodium Gluconate Retarder And Dispersants, Tae Yong Shin, Seongho Han, Ryong You, Yubin Jun, Jae Hong Kim

Civil, Architectural and Environmental Engineering Faculty Research & Creative Works

Alkali-activated materials have emerged as promising low-carbon alternatives to ordinary Portland cement-based binders; however, their practical application is strictly limited by rapid setting and poor workability. To address these challenges, this study proposes an evaluation methodology combining setting time measurement, cloud point tests for chemical stability, and wide-range rheological analysis. While conventional superplasticizers like polycarboxylate ether (PCE) proved unstable in high-alkaline environments, cloud point tests revealed that polynaphthalene sulfonate (PNS) and butyl acrylate (BA) exhibited superior chemical stability. Notably, BA was identified as a novel and effective dispersant in 3.5 M KOH-activated systems, reducing yield stress of fresh mortar by …

Neuproio: A Dual-Action Solid Drug Nanoparticle Topical Formulation For Simultaneous Intraocular Pressure Reduction And Neuroprotection For Glaucoma, Lei Xu, Mu Li, Lin Qi, Tzu Chen Wang, Dong Liu, Vimalin Jeyalatha Mani, Hsin Yin Chuang, Qingbo Yang, Ruipu Mu, Samira Mahdi, Da Huang, Honglan Shi, Yang Hu, Hu Yang

Chemical and Biochemical Engineering Faculty Research & Creative Works

Glaucoma is a leading cause of irreversible blindness, primarily due to elevated intraocular pressure (IOP) that damages the retina and optic nerve. Most topical glaucoma treatments focus solely on IOP-lowering without direct neuroprotection, as drug delivery to the posterior eye is challenging. Here, we developed NeuProIO, a dual-action solid drug nanoparticle (NP) eye drop for simultaneous IOP reduction and neuroprotection. Using flash nanoprecipitation in a multi-inlet vortex mixer, we fabricated the first NeuProIO solid drug NPs incorporating the repurposed neuroprotective agent maprotiline (MAP) and the IOP-lowering agent betaxolol (BX), forming MAP/BX NPs for synergistic glaucoma treatment. The NeuProIO improved stability …

Long-Range Fit: A Software Package For The Representation And Study Of Long-Range Molecular Interactions, Adrian L. Batista-Planas, Ernesto Quintas-Sánchez, Richard Dawes

Chemistry Faculty Research & Creative Works

Describing intermolecular forces is fundamental to modeling and predicting the behavior of molecular systems. In particular, long-range molecular interactions with electrostatic, induction, and dispersion as the main components play a critical role, especially for low-temperature and low-density regimes. Long-range interactions are often described through perturbation theory, representing the electronic charge distribution via a multipolar series of the moments and polarizability tensors corresponding to each molecule. However, while the theory is well established, obtaining the resulting analytical expressions (and their practical implementation) constitutes a highly complex and system-dependent task. To address this challenge, we developed long-range-fit (LRF), an interactive and user-friendly …

Cationic Poly(Glucosamine)-Based Polymers Bind To Glycans With Varying Affinity Facilitating Transport Across The Glycocalyx Of Endothelial Cells, Claire Bridges, Lu Fu, Dan Wang, James D. Sterling, Susanna Liang, Shenda M. Baker, Jonathan Yeow, Megan S. Lord

Business and Information Technology Faculty Research & Creative Works

Natural polysaccharides, such as chitosan, offer promising avenues for drug delivery due to their cytocompatibility and ability to interact with cell surfaces. However, the endothelial glycocalyx, a glycan-rich extracellular matrix, presents a barrier that must be navigated for effective intracellular delivery. This study investigates how cationic poly(glucosamine)-based polymers, functionalized with guanidinium or ammonium groups, interact with key glycocalyx components including hyaluronan (HA) and heparan sulfate (HS). We demonstrate that these cationic polymers form tunable biomolecular condensates with glycans, with stronger binding observed for sulfated glycans, HS and heparin, than unsulfated HA. Derivatized chitosan polymers with varied cationic side chains exhibit …

Early Detection Of Infectious Diseases: A Review Of Recent Advances In Pathogen Identification, Molecular Tools, And Metabolomics-Driven Biomarker Discovery, Patrica Ivy Agorsor, Michael O. Eze

Chemistry Faculty Research & Creative Works

The recent COVID-19 pandemic has heightened public interest in noninvasive methods for early diagnosis of infectious diseases. In addition, various government agencies have implemented "infectious disease preparedness" to mitigate future outbreaks. This review highlights conventional and advanced methods for infectious disease diagnosis with an emphasis on emerging mass spectrometry methods. Conventional methods for pathogen identification, such as culture-based techniques and molecular methods, have limitations with respect to sensitivity, specificity, and turnaround time. Recent advances in high-resolution mass spectrometry have revolutionized the field of infectious disease biomarker discovery. These techniques enable the comprehensive profiling of metabolites in various biological samples, identification …

Probing Proximal Intramolecular Hydrogen Bonding Interactions On A Norbornane Scaffold, Carly A. Rock, Dakota B. Green, Martin J. Flores, Jeremy M. Carr, Thufail M. Ismail, Gregory S. Tschumper

Chemistry Faculty Research & Creative Works

A systematic computational study was conducted on 12 unique 2,6-disubstituted norbornane derivatives to assess the ability of various acceptor groups (A = F, Cl, Br, OH, OCH3, SH, SCH3, NHCH3, N(CH3)2, PH2, PHCH3, and P(CH3)2) to engage in intramolecular hydrogen bonding with a proximal OH donor. 32 unique minima have been characterized with M06-2X and df-MP2 geometry optimizations as well as PNO-LCCSD(T)-F12 single point energy computations. Conformations with the OH donor oriented toward the acceptor to form an OH···A contact (+HB) consistently had lower electronic energies (by approximately 2 to 8 kcal mol^–1) than their counterparts with the …

Reflections On Linear B (Part 14) – Sign 76 (With Two Parallel Wavy Lines Pronounced /Ra/); Possible Derivation From The River Traveled Nightly By The Sun God Ra., Gerald Leonard Cohen

Arts, Languages and Philosophy Faculty Research & Creative Works

This article suggests that the two parallel wavy lines in Linear B sign 76 depict the river traveled nightly by the Egyptian sun god Ra. Also:

1. The Egyptian influence was likely exerted already on the Linear A and Cretan hieroglyphic antecedents of Linear B sign 76.

2. Variants of Linear B sign 76 contain a horizontal line across the two wavy vertical lines. The present article suggests the horizontal line might indicate one of the river’s twelve gates that Ra had to navigate through in his nightly journey.

3. But the single line for that one gate was likely …

Use Of Gamma-Ray Spectroscopy In Thickness Gauging Of A Complex-Shaped Lead Shield, Joseph T. Graham, Brian Durtschi, Ashish Avachat, Seth Kilby

Nuclear Engineering and Radiation Science Faculty Research & Creative Works

Methods for measuring the thickness of lead shielding based on ⁶⁰Co gamma-ray spectroscopy are presented. In applications where a shield's thickness is multiple mean free paths and the shield has a complex shape (i.e. cannot be approximated as a simple solid such as a slab, sphere, semi-infinite medium, etc.), the necessary buildup factors are not available. Thus, determination of shield thickness by means of the Beer–Lambert law requires separating the counts from uncollided photons from the scattered photon contribution. It is demonstrated how the 1332 keV gamma ray of ⁶⁰Co can be used to precisely quantify lead thicknesses …

Modeling And Characterizing The Electron Backscatter In A Cylindrical Anode-Based Distributed X-Ray Source, Jordan Fox, Seth Kilby, Hyoung Koo Lee, Ayodeji Alajo, Ashish Avachat

Nuclear Engineering and Radiation Science Faculty Research & Creative Works

Upcoming advancements in computed tomography architectures warrants the investigation of new X-ray source designs and the impacts that electron backscatter can have on these designs. One such design being investigated is a distributed, cylindrical anode-based X-ray source. For such a distributed X-ray source, we developed a modeling pipeline for simulating electron optics and transport to characterize the quality of the primary X-ray beam and the electron backscatter behavior. We report our results on the energy distributions of the bremsstrahlung spectra; electron backscatter ratio; and spatial, temporal, and energy distributions of backscattered electrons that return to the anode.

Full Core Fuel Burnup Assessment Of The Itu Triga Mark Ii Research Reactor Using Gamma Spectroscopy, Z. Boduroglu, A. Kaya, O. Erbay, I. A. Reyhancan, M. S. Kiziltas, T. Akyurek

Nuclear Engineering and Radiation Science Faculty Research & Creative Works

This study investigates the burnup distribution of fuel elements in the ITU TRIGA Mark II research reactor core through gamma spectroscopy using¹³⁷Cs as a burnup indicator. Non-Destructive Assay (NDA) techniques were employed to analyze fuel depletion, utilizing a specialized fuel investigation system installed above the reactor pool. The results indicate that the highest burnup values, exceeding 5 %, were concentrated in the inner core rings (B and C) due to intense neutron flux exposure, while the outer rings (D, E, F) exhibited lower burnup levels. To address this asymmetric distribution, a proposed fuel reshuffling strategy was analyzed, aiming …

Positive Solutions Of Semipositone Singular Three-Points Boundary Value Problems For Nonlinear Fractional Differential Equations, Xueyan Zhang, Zhaocai Hao, Martin Bohner

Mathematics and Statistics Faculty Research & Creative Works

This study introduces the existence of one positive solution for a specific category of semipositive singular three-point boundary value problems associated with Caputo fractional differential equations. The proof relies on the application of the Guo–Krasnosel'skii fixed point theorem. In the end, we provide an illustrative example.

How To Measure, Analyze, And Interpret Age-Related Changes In Caenorhabditis Elegans: Lessons For Mechanistic And Evolutionary Theories Of Aging, Zuzana Kocsisova, Brian M. Egan, Andrea Scharf, Xavier Anderson, Franziska Pohl, Aaron Anderson, Kerry Kornfeld

Biological Sciences Faculty Research & Creative Works

Aging is characterized by progressive degenerative changes in tissue organization and function, some of which increase the probability of mortality. Major goals of aging research are to elucidate the series of events that cause degenerative changes, and to identify environmental, pharmacological, and genetic factors that influence these changes; this information might lead to new strategies to extend health span and lifespan. Mechanistic studies of aging depend on accurate and precise descriptions of age-related changes, since these descriptions define the aging phenotype. Here, we review studies that describe age-related changes in C. elegans, including measurements of integrated functions such as behavior …

Nondestructive Burnup Evaluation And Gamma Spectroscopy Analysis Of Spent Fuel Elements In The Itu Triga Mark Ii Research Reactor, A. Kaya, O. Erbay, Z. Boduroglu, I. A. Reyhancan, M. S. Kiziltas, T. Akyurek

Nuclear Engineering and Radiation Science Faculty Research & Creative Works

This study presents a comprehensive burnup analysis of all fuel elements in the ITU TRIGA Mark II research reactor core using non-destructive assay (NDA) techniques based on gamma spectroscopy. Two distinct fuel inspection systems were employed to measure the gamma activity, with¹³⁷Cs used as the primary burnup indicator due to its strong correlation with fuel depletion. The results show a clear burnup pattern, with higher values in the inner core rings that gradually decreases toward the outer rings. This asymmetric burnup distribution underscores the need for reactor core reconfiguration, for which an optimized layout is proposed. Additionally, gamma …

Advances And Challenges In Nano-Modified Cementitious Composites: Mechanisms, Dispersion Strategies, And Impact On Mechanical Properties, Fatemeh Mohammadi Ghahsareh, Pengwei Guo, Nusrath Jaha, Yi Bao, Kamal H. Khayat, Weina Meng

Civil, Architectural and Environmental Engineering Faculty Research & Creative Works

Nanomaterials are increasingly utilized to enhance the mechanical properties, durability, and functionality of concrete materials but face challenges such as agglomeration and uneven dispersion in cementitious systems, which can offset the intended improvements. This paper reviews the advances and challenges associated with nano-modified cementitious composites, elucidating fundamental mechanisms and highlighting strategies for overcoming the challenges through experimental and computing techniques. The reviewed contents include (1) the classification of nanomaterials commonly used in cementitious systems and the mechanisms through which they enhance the mechanical properties of cementitious composites; (2) challenges of nanomaterials such as agglomeration in water, re-agglomeration in cementitious systems, …

Integrated Computational And Experimental Investigation Of Groups V And Vi Metals In (M,Hf,Ti,Zr)B2-(M,Hf,Ti,Zr)C Ceramics, Ana C. Feltrin, Simon Divilov, Gregory E. Hilmas, Stefano Curtarolo, William G. Fahrenholtz

Materials Science and Engineering Faculty Research & Creative Works

Dual-phase compositionally complex ultra-high temperature ceramics were formulated by incorporating different Groups V and VI metals such as V, Nb, Ta, Cr, Mo, or W into a base composition containing the Group IV elements, Hf, Ti, and Zr. Metal distribution was predicted using first-principles-based thermodynamics simulations and compared with experimental results. Moreover, phase stability, microstructure, and mechanical properties were evaluated for all of the ceramics. Compositions containing Cr, V, Nb, or Ta formed dual-phase ceramics containing only one boride and one carbide phase, while compositions containing Mo or W developed an additional third phase. The experimental metal distribution trends generally …